Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTHQIVTTQYGKVKGTTENGVHKWKGIPYAKPPVGQWRFKAPEPPEVWEDVLDATAYGSICP-----QPSDLLSLSYTELPRQSEDCLYVNVFAPDTP-SKNLPVMVWIHGGAFYLGAGSE-PLYDGSKLAAQGEVIVVTLNYRLGPFGFLHLSSFNEAY--SDNLGLLDQAAALKWVRENISAFGGDPDNVTVFGESAGGMSIAALLAMPAAKGLFQKAIMESGASRTMTKEQAASTS---AAFLQVLGINEGQLDKLHTVSAEDLLKAADQLRIAEKENIFQLFFQPALDPKTLPEEPEKAIAEGAASGIPLLIGTTRDEGYLFFTP-DSDVHSQETLDAALEYLL---GKPLAEKVADLYPRSLESQIHMMT-DLLFWRPAVAY-----ASAQSHYAPVWMYRFDWHPKKPPYNKAFHALELPFVFGNLDGLERMAKAEITDEVKQLSHTIQSAWITFAKTGNPSTEAV-NWPAYHEETRETLILDSEITIENDPESEKRQKLFPSKGE 5A2G Chain:B ((12-487)) ----VVETKAGKLRGYQWEGTYIFKGIRYARAN----RFQLPEEVEPWEGVKEAASYGFVCPMLTRDHPQGELLVPHRYWP-QDEDCLSLNIWSQSLDRSAKKPVMFWIHGGAFSMGSSIEQKAYNGENMSRYGDVVVVTVNHRLNILGYLDLSPYGERYAGSANAGQADLVAALKWVRDNIEAFGGDPDNVTIFGQSGGGMKVSGLMQTPEADGLFHRAMIMSGVAGDVLPYSTGDSRPLIQAMLKELGLAEQEAGRLETVPYYDLAAAYNRVSPAIARAGGYIGCTPRPDDFYKGEGPAVGFTDHAKT-IPVMVGTVFGEFAMMPLPFNKETISEAELDEILDKRFQGHGKELKTVFAEAYPG--KSPVDLLTLDTIFRGPTKEFVRSLAAAGGSVYSYLFALEFPYQNQK----TAWHCSDIPFIFHNTELVPVTNIPEISD---KLEKQMFDAVIHFVETGDPNHLGIPQWPVSTEDREATMIFDRVCTVR-----------------

General information: TITO was launched using: RESULT: Template: 5A2G.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 2655 23712 8.93 52.34 target 2D structure prediction score : 0.53 Monomeric hydrophicity matching model chain B : 0.76 3D Compatibility (PKB) : 8.93 2D Compatibility (Sec. Struct. Predict.) : 0.53 1D Compatibility (Hydrophobicity) : 0.76 QMean score : 0.550

(partial model without unconserved sides chains): PDB file : Tito_5A2G.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5A2G-query.scw PDB file : Tito_Scwrl_5A2G.pdb: